Information card for entry 2243902

Structure parameters

• Chemical name: <i>catena</i>-Poly[[hexaaqua{μ~3~-2-[bis(carboxylatomethyl)amino]terephthalato}dicobalt(II)] pentahydrate]
• Formula: C12 H29 Co2 N O19
• Calculated formula: C12 H29 Co2 N O19
• Title of publication: Synthesis and crystal structure of <i>catena</i>-poly[[hexaaqua{μ~3~-2-[bis(carboxylatomethyl)amino]terephthalato}dicobalt(II)] pentahydrate] containing water tapes and pentamers
• Authors of publication: Ma, Jie; Zhang, Wen-Zhi; Xiong, Jie; Yan, Chun-Yan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2021
• Journal volume: 77
• Journal issue: 9
• a: 9.7653 ± 0.0015 Å
• b: 11.725 ± 0.002 Å
• c: 11.8191 ± 0.0015 Å
• α: 64.882 ± 0.005°
• β: 71.276 ± 0.007°
• γ: 86.692 ± 0.008°
• Cell volume: 1155.6 ± 0.3 ų
• Cell temperature: 293.15 K
• Ambient diffraction temperature: 293.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0307
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.0673
• Weighted residual factors for all reflections included in the refinement: 0.0685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes